SCHEMBL9857583

SCHEMBL9857583

Nc1nc2c(ncn2OCCCOCP(=O)(O)O)c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 10/20 0.61
PNP P00491 9/20 0.59
POLB P06746 2/20 0.55
POLA1 P09884 1/20 0.53
POLG P54098 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9417159 0.93 HPRT1 (0.63) HPRT1PNPPOLBPOLA1POLG
SCHEMBL9857607 0.88 POLB (0.57) HPRT1PNPPOLBPOLA1POLG
SCHEMBL9684292 0.88 HPRT1 (0.69) HPRT1PNP
SCHEMBL9576789 0.88 HPRT1 (0.64) HPRT1PNPPOLB
Ammonia Solution, Strong SCHEMBL9126206 0.87 HPRT1 (0.63) HPRT1PNPPOLB
Ammonia Solution, Strong SCHEMBL9126217 0.87 HPRT1 (0.63) HPRT1PNPPOLB
SCHEMBL9683440 0.87 PNP (0.70) HPRT1PNP
SCHEMBL9858353 0.85 PNP (0.52) HPRT1PNPPOLBPOLA1POLG
SCHEMBL9858344 0.85 HPRT1 (0.58) HPRT1PNPPOLBPOLA1POLG
SCHEMBL8905164 0.83 HPRT1 (0.72) HPRT1PNPPOLBPOLA1POLG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US claimed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP claimed
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 US disclosed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 EP disclosed